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M-Cresol, 6-propyl-

CAT: 0931-T33238-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T33238-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
31143-55-2
Target
Others
Related Pathways
Others
Bioactivity
M-Cresol, 6-propyl- is a bioactive chemical.
Smiles
OC1=CC(=CC=C1CCC)C
Molecular Formula
C10H14O
Molecular Weight
150.22
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

3-Methyl-6-propylphenol

m-Cresol, 6-propyl- has been reported in Glycyrrhiza glabra with data available.

CAS Number31143-55-2
PubChem CID35743
IUPAC Name5-methyl-2-propylphenol
Molecular FormulaC10H14O
Molecular Weight150.22
XLogP3.3
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity111
SMILES
CCCC1=C(C=C(C=C1)C)O
InChI
InChI=1S/C10H14O/c1-3-4-9-6-5-8(2)7-10(9)11/h5-7,11H,3-4H2,1-2H3
InChIKey
NGSJNQJPYFYNJV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Methyl-6-propylphenol
CAS: 31143-55-2
CID: 35743
Formula: C10H14O
MW: 150.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight150.22
XLogP33.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass150.104465066
Monoisotopic Mass150.104465066
Topological Polar Surface Area20.2 Ų
Heavy Atom Count11
Formal Charge0
Complexity111
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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